N-butan-2-yl-2-(2-methoxyethoxy)acetamide

C9H19NO3 — CID 60650985

IUPACN-butan-2-yl-2-(2-methoxyethoxy)acetamide
SMILESCCC(C)NC(=O)COCCOC
InChIInChI=1S/C9H19NO3/c1-4-8(2)10-9(11)7-13-6-5-12-3/h8H,4-7H2,1-3H3,(H,10,11)
InChIKeyDJSCGQASCJBIOF-UHFFFAOYSA-N
MW189.25 g/mol
LogP0.56
Rot. Bonds7

About N-butan-2-yl-2-(2-methoxyethoxy)acetamide

N-butan-2-yl-2-(2-methoxyethoxy)acetamide (PubChem CID 60650985) has the molecular formula C9H19NO3 and a molecular weight of 189.25 g/mol. Its IUPAC name is N-butan-2-yl-2-(2-methoxyethoxy)acetamide.

Molecular Properties

Compound NameN-butan-2-yl-2-(2-methoxyethoxy)acetamide
PubChem CID60650985
Molecular FormulaC9H19NO3
Molecular Weight189.25 g/mol
Exact Mass189.14
IUPAC NameN-butan-2-yl-2-(2-methoxyethoxy)acetamide
SMILESCCC(C)NC(=O)COCCOC
InChIInChI=1S/C9H19NO3/c1-4-8(2)10-9(11)7-13-6-5-12-3/h8H,4-7H2,1-3H3,(H,10,11)
InChIKeyDJSCGQASCJBIOF-UHFFFAOYSA-N
XLogP0.56
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.25
LogP ≤ 50.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(2-methoxyethoxy)-N-pentan-2-ylacetamide
CID 103601639
2-(2-methoxyethoxy)-N-(6-methylheptan-2-yl)acetamide
CID 86977751
(2S)-2-[[2-(2-methoxyethoxy)acetyl]amino]-3-methylpentanoic acid
CID 61172189
N-[(2R)-1-hydroxybutan-2-yl]-2-(2-methoxyethoxy)acetamide
CID 103920046
2-[2-[2-oxo-2-(propan-2-ylamino)ethoxy]ethoxy]-N-propan-2-ylacetamide
CID 166950643
N-(1-hydroxy-3-methylbutan-2-yl)-2-(2-methoxyethoxy)acetamide
CID 79255861
N-butan-2-yl-3-[3-(2-methoxyethoxy)propylamino]propanamide
CID 103409413
2-methoxy-N-(4-methoxybutan-2-yl)acetamide
CID 62612246
2-(2-amino-2-ethylbutoxy)-N-butan-2-ylacetamide
CID 64571661
N-ethyl-2-(2-methoxyethoxy)acetamide
CID 60651065
2-(2-methoxyethoxy)-N-(1-phenylpropyl)acetamide
CID 103612351
methyl 3-hydroxy-2-[[2-(2-methoxyethoxy)acetyl]amino]propanoate
CID 43422807

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-2-(2-methoxyethoxy)acetamide?
The IUPAC name of N-butan-2-yl-2-(2-methoxyethoxy)acetamide (CID 60650985) is N-butan-2-yl-2-(2-methoxyethoxy)acetamide.
What is the SMILES notation for N-butan-2-yl-2-(2-methoxyethoxy)acetamide?
The canonical SMILES for N-butan-2-yl-2-(2-methoxyethoxy)acetamide is CCC(C)NC(=O)COCCOC.
What is the InChIKey of N-butan-2-yl-2-(2-methoxyethoxy)acetamide?
The InChIKey is DJSCGQASCJBIOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO3/c1-4-8(2)10-9(11)7-13-6-5-12-3/h8H,4-7H2,1-3H3,(H,10,11).
What are the key properties of N-butan-2-yl-2-(2-methoxyethoxy)acetamide?
N-butan-2-yl-2-(2-methoxyethoxy)acetamide has a molecular weight of 189.25 g/mol, XLogP of 0.56, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-2-(2-methoxyethoxy)acetamide is sourced from PubChem (CID 60650985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).